CID 67222802

1822562-98-0

Structural Information

Molecular Formula
C10H17NO4
SMILES
CC1CN(C1C(=O)O)C(=O)OC(C)(C)C
InChI
InChI=1S/C10H17NO4/c1-6-5-11(7(6)8(12)13)9(14)15-10(2,3)4/h6-7H,5H2,1-4H3,(H,12,13)
InChIKey
CWCHGLNUHDOFHF-UHFFFAOYSA-N
Compound name
3-methyl-1-[(2-methylpropan-2-yl)oxycarbonyl]azetidine-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

215.11575 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.12303 152.6
[M+Na]+ 238.10497 156.2
[M+NH4]+ 233.14957 153.5
[M+K]+ 254.07891 156.1
[M-H]- 214.10847 147.1
[M+Na-2H]- 236.09042 150.8
[M]+ 215.11520 150.0
[M]- 215.11630 150.0
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