CID 10080852

(s)-n-boc-2,3-epoxypropylamine

Structural Information

Molecular Formula
C8H15NO3
SMILES
CC(C)(C)OC(=O)NC[C@H]1CO1
InChI
InChI=1S/C8H15NO3/c1-8(2,3)12-7(10)9-4-6-5-11-6/h6H,4-5H2,1-3H3,(H,9,10)/t6-/m0/s1
InChIKey
ZBBGKXNNTNBRBH-LURJTMIESA-N
Compound name
tert-butyl N-[[(2S)-oxiran-2-yl]methyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

430
Patents

173.1052 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.112476 138.5
[M+Na]+ 196.094418 146.7
[M-H]- 172.097924 144.0
[M+NH4]+ 191.139023 152.9
[M+K]+ 212.068358 146.9
[M+H-H2O]+ 156.102460 132.7
[M+HCOO]- 218.103401 160.4
[M+CH3COO]- 232.119051 183.9
[M+Na-2H]- 194.079866 145.9
[M]+ 173.10465142 143.9
[M]- 173.10574858 143.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe