CID 105453038

1903427-97-3

Structural Information

Molecular Formula
C10H20N2O2
SMILES
CC(C)(C)OC(=O)NC[C@@H]1C[C@H]1CN
InChI
InChI=1S/C10H20N2O2/c1-10(2,3)14-9(13)12-6-8-4-7(8)5-11/h7-8H,4-6,11H2,1-3H3,(H,12,13)/t7-,8-/m0/s1
InChIKey
IQRRHMJDTILEKX-YUMQZZPRSA-N
Compound name
tert-butyl N-[[(1R,2R)-2-(aminomethyl)cyclopropyl]methyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

200.15248 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.15976 145.1
[M+Na]+ 223.14170 152.5
[M-H]- 199.14520 149.3
[M+NH4]+ 218.18630 159.4
[M+K]+ 239.11564 150.2
[M+H-H2O]+ 183.14974 139.4
[M+HCOO]- 245.15068 167.6
[M+CH3COO]- 259.16633 193.1
[M+Na-2H]- 221.12715 149.2
[M]+ 200.15193 147.9
[M]- 200.15303 147.9
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

No patent data available for this compound.