CID 52278072

1374970-04-3

Structural Information

Molecular Formula
C10H20N2O2
SMILES
CC(C)(C)OC(=O)N[C@H](CN)C1CC1
InChI
InChI=1S/C10H20N2O2/c1-10(2,3)14-9(13)12-8(6-11)7-4-5-7/h7-8H,4-6,11H2,1-3H3,(H,12,13)/t8-/m1/s1
InChIKey
YXKXVKFAISFJPS-MRVPVSSYSA-N
Compound name
tert-butyl N-[(1S)-2-amino-1-cyclopropylethyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

200.15248 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.15976 144.8
[M+Na]+ 223.14170 151.2
[M-H]- 199.14520 148.8
[M+NH4]+ 218.18630 158.7
[M+K]+ 239.11564 149.3
[M+H-H2O]+ 183.14974 139.0
[M+HCOO]- 245.15068 166.5
[M+CH3COO]- 259.16633 192.7
[M+Na-2H]- 221.12715 148.5
[M]+ 200.15193 146.7
[M]- 200.15303 146.7
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