Spectrum BML01464 for N-alpha-(tert-Butoxycarbonyl)-L-histidine

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Compound Information

Chemical Names

Compound Classification (provided by ClassyFire)

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Compound Metadata

NameValue
InChI=1S/C11H17N3O4/c1-11(2,3)18-10(17)14-8(9(15)16)4-7-5-12-6-13-7/h5-6,8H,4H2,1-3H3,(H,12,13)(H,14,17)(H,15,16)
AYMLQYFMYHISQO-UHFFFAOYSA-N
C11H17N3O4
255.121906024
O=C(O)C(N=C(O)OC(C)(C)C)CC1=CN=CN1

Mass Spectral Metadata

NameValue
BML01464
2016.01.19 (Created 2012.10.26)
Cuthbertson DJ, Johnson SR, Lange BM, Institute of Biological Chemistry, Washington State University
LC-ESI-QTOF
MS2
10 ev
N2
m/z 100-1000
CC BY-SA
relative retention time with respect to 9-anthracene Carboxylic Acid is 0.276
255.121906
Agilent 1200 RRLC; Agilent 6520 QTOF
Agilent C8 Cartridge Column 2.1X30mm 3.5 micron (guard); Agilent SB-Aq 2.1x50mm 1.8 micron (analytical)
60 C
linear from 98A/2B at 0 min to 2A/98B at 13 min, hold 6 min at 2A/98B, reequilibration 98A/2B (5 min)
0.6 ml/min
2.041
water with 0.2% acetic acid
methanol with 0.2% acetic acid
positive
0.9103072626821325
0.6566478867783597
256.1292
[M+H]+
2.6393866844238403 ppm
-6.760239999721307E-4 Da