CID 73977918

1523617-99-3

Structural Information

Molecular Formula
C10H17NO3
SMILES
CC1(CC(=O)C1)NC(=O)OC(C)(C)C
InChI
InChI=1S/C10H17NO3/c1-9(2,3)14-8(13)11-10(4)5-7(12)6-10/h5-6H2,1-4H3,(H,11,13)
InChIKey
DPLRVTIHVYBKPN-UHFFFAOYSA-N
Compound name
tert-butyl N-(1-methyl-3-oxocyclobutyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

199.12085 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.128126 146.3
[M+Na]+ 222.110068 151.5
[M-H]- 198.113574 150.0
[M+NH4]+ 217.154673 161.0
[M+K]+ 238.084008 154.6
[M+H-H2O]+ 182.118110 137.3
[M+HCOO]- 244.119051 166.4
[M+CH3COO]- 258.134701 189.3
[M+Na-2H]- 220.095516 151.1
[M]+ 199.12030142 156.1
[M]- 199.12139858 156.1
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