CID 53302198

2231674-63-6

Structural Information

Molecular Formula
C10H20N2O2
SMILES
CC1(CNC1)N(C)C(=O)OC(C)(C)C
InChI
InChI=1S/C10H20N2O2/c1-9(2,3)14-8(13)12(5)10(4)6-11-7-10/h11H,6-7H2,1-5H3
InChIKey
MRDWQZXOUCMQBF-UHFFFAOYSA-N
Compound name
tert-butyl N-methyl-N-(3-methylazetidin-3-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
Patents

200.15248 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.15976 152.0
[M+Na]+ 223.14170 155.9
[M-H]- 199.14520 154.0
[M+NH4]+ 218.18630 165.1
[M+K]+ 239.11564 159.5
[M+H-H2O]+ 183.14974 141.8
[M+HCOO]- 245.15068 169.5
[M+CH3COO]- 259.16633 190.4
[M+Na-2H]- 221.12715 155.9
[M]+ 200.15193 160.5
[M]- 200.15303 160.5
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