CID 10823469

Tert-butyl n-{2-[methoxy(methyl)carbamoyl]ethyl}carbamate

Structural Information

Molecular Formula
C10H20N2O4
SMILES
CC(C)(C)OC(=O)NCCC(=O)N(C)OC
InChI
InChI=1S/C10H20N2O4/c1-10(2,3)16-9(14)11-7-6-8(13)12(4)15-5/h6-7H2,1-5H3,(H,11,14)
InChIKey
SFDSZSRXXGFFEH-UHFFFAOYSA-N
Compound name
tert-butyl N-[3-[methoxy(methyl)amino]-3-oxopropyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

57
Patents

232.1423 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.149576 154.1
[M+Na]+ 255.131518 158.8
[M-H]- 231.135024 155.6
[M+NH4]+ 250.176123 172.3
[M+K]+ 271.105458 161.1
[M+H-H2O]+ 215.139560 148.3
[M+HCOO]- 277.140501 177.1
[M+CH3COO]- 291.156151 198.1
[M+Na-2H]- 253.116966 157.3
[M]+ 232.14175142 158.8
[M]- 232.14284858 158.8
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