CID 11218578

Tert-butyl n-[(4-methoxyphenyl)methylene]carbamate

Structural Information

Molecular Formula
C13H17NO3
SMILES
CC(C)(C)OC(=O)/N=C/C1=CC=C(C=C1)OC
InChI
InChI=1S/C13H17NO3/c1-13(2,3)17-12(15)14-9-10-5-7-11(16-4)8-6-10/h5-9H,1-4H3/b14-9+
InChIKey
OLARTLQIVCKFTH-NTEUORMPSA-N
Compound name
tert-butyl (NE)-N-[(4-methoxyphenyl)methylidene]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

235.12085 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 236.12813 153.9
[M+Na]+ 258.11007 164.9
[M+NH4]+ 253.15467 160.8
[M+K]+ 274.08401 159.6
[M-H]- 234.11357 155.2
[M+Na-2H]- 256.09552 159.7
[M]+ 235.12030 155.7
[M]- 235.12140 155.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

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